(2R)-2-acetamido-3-(1,1-dibromo-2,2-difluoroethyl)sulfanylpropanoic acid
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(2R)-2-acetamido-3-(1,1-dibromo-2,2-difluoroethyl)sulfanylpropanoic acid
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CAS No:
119018-03-0
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Formula:
C7H9Br2F2NO3S
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Chemical Name:
(2R)-2-acetamido-3-(1,1-dibromo-2,2-difluoroethyl)sulfanylpropanoic acid
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Synonyms:
DBDFE-NAC;N-acetyl-S-(1,1-dibromo-2,2-difluoroethyl)-1-cysteine;119018-03-0;Dbdfe-nac;N-Acetyl-S-(1,1-dibromo-2,2-difluoroethyl)-1-cysteine;L-Cysteine, N-acetyl-S-(1,1-dibromo-2,2-difluoroethyl)-;DTXSID40922853;N-Acetyl-S-(1,1-dibromo-2,2-difluoroethyl)-L-cysteine;S-(1,1-Dibromo-2,2-difluoroethyl)-N-(1-hydroxyethylidene)cysteine
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CAS No:
(2R)-2-acetamido-3-(1,1-dibromo-2,2-difluoroethyl)sulfanylpropanoic acid Basic Attributes
385.02 g/mol
384.86175 g/mol
Computed Properties
Molecular Weight:385.02
XLogP3:2.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:6
Exact Mass:384.86175
Monoisotopic Mass:382.86380
Topological Polar Surface Area:91.7
Heavy Atom Count:16
Complexity:278
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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